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8-Chloro-3-methoxy-11-(1-methyl-4-piperidinyl)-6,11-dihydro-5H-benzo[5,6]-cyclohepta[1,2-b]pyridin-11-ol-[d4]

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8-Chloro-3-methoxy-11-(1-methyl-4-piperidinyl)-6,11-dihydro-5H-benzo[5,6]-cyclohepta[1,2-b]pyridin-11-ol-[d4]

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General Information
Catalog: BLP-007752
CAS: 1189492-69-0
Molecular Formula: C21H21D4ClN2O2
Molecular Weight: 376.91

Chemical Structure

Description	Labelled 8-Chloro-3-methoxy-11-(1-methyl-4-piperidinyl)-6,11-dihydro-5H-benzo[5,6]-cyclohepta[1,2-b]pyridin-11-ol.
IUPAC Name	13-chloro-6-methoxy-2-(2,2,6,6-tetradeuterio-1-methylpiperidin-4-yl)-4-azatricyclo[9.4.0.03,8]pentadeca-1(11),3(8),4,6,12,14-hexaen-2-ol
Related CAS	165739-71-9 (unlabelled)
Isomeric SMILES	[2H]C1(CC(CC(N1C)([2H])[2H])C2(C3=C(CCC4=C2N=CC(=C4)OC)C=C(C=C3)Cl)O)[2H]
Canonical SMILES	CN1CCC(CC1)C2(C3=C(CCC4=C2N=CC(=C4)OC)C=C(C=C3)Cl)O
InChI	InChI=1S/C21H25ClN2O2/c1-24-9-7-16(8-10-24)21(25)19-6-5-17(22)11-14(19)3-4-15-12-18(26-2)13-23-20(15)21/h5-6,11-13,16,25H,3-4,7-10H2,1-2H3/i9D2,10D2
InChI Key	RMNIHJQGNNEPGE-YQUBHJMPSA-N
Melting Point	129-131°C
Purity	>98%
Solubility	Soluble in Chloroform, Dichloromethane, Ethyl Acetate, Methanol
Appearance	Pale Yellow Solid